1-(2-chloranyl-5-nitro-phenyl)sulfonyl-N-[4-[2-(methylamino)-2-oxidanylidene-ethyl]phenyl]piperidine-4-carboxamide

Systemtic Name: 1-(2-chloranyl-5-nitro-phenyl)sulfonyl-N-[4-[2-(methylamino)-2-oxidanylidene-ethyl]phenyl]piperidine-4-carboxamide Openeye Name: 1-(2-chloro-5-nitro-phenyl)sulfonyl-N-[4-[2-(methylamino)-2-oxo-ethyl]phenyl]piperidine-4-carboxamide CAS Name: 1-(2-chloro-5-nitrophenyl)sulfonyl-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(2-chloro-5-nitrophenyl)sulfonyl-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]piperidine-4-carboxamide Traditional Name: 1-(2-chloro-5-nitro-phenyl)sulfonyl-N-[4-[2-keto-2-(methylamino)ethyl]phenyl]isonipecotamide Formula: C21H23ClN4O6S MolecularWeight: 494.94852

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CC1=CC=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CNC(=O)CC1=CC=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C21H23ClN4O6S/c1-23-20(27)12-14-2-4-16(5-3-14)24-21(28)15-8-10-25(11-9-15)33(31,32)19-13-17(26(29)30)6-7-18(19)22/h2-7,13,15H,8-12H2,1H3,(H,23,27)(H,24,28)